SCHEMBL17836973

SCHEMBL17836973

O=C(O)c1cc(I)c(O)c(I)c1CCc1c(C(=O)O)cc(I)c(O)c1I

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
TP53 P04637 2/20 0.44
TPMT P51580 1/20 0.38
TTR P02766 2/20 0.36
HMGB1 P09429 3/20 0.34
HPGD P15428 2/20 0.34
CXCL12 P48061 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PTPN1 P18031 1/20 0.34
POLB P06746 1/20 0.34
GPR35 Q9HC97 1/20 0.34
SIRT5 Q9NXA8 1/20 0.34
THRB P10828 2/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
CTRB1 P17538 1/20 0.34
ALOX12 P18054 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17836998 0.91 TDP1 (0.42) TDP1TP53TPMTTTRHMGB1
SCHEMBL17836974 0.85 ESR1 (0.55) TDP1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL17836991 0.84 SMN1; SMN2 (0.36) TDP1TP53KMT2A
SCHEMBL31491424 0.79 TP53 (0.58) TDP1TP53TPMTTTRHMGB1
SCHEMBL18281063 0.74 TP53 (0.45) TDP1TP53TPMTTTRHMGB1
SCHEMBL1043966 0.74 TP53 (0.45) TDP1TP53TPMTTTRHPGD
SCHEMBL19730670 0.73 TP53 (0.50) TP53TPMTTTRHMGB1HPGD
SCHEMBL30211325 0.71 TP53 (0.58) TP53TPMTTTRHMGB1HPGD
SCHEMBL607243 0.71 TP53 (0.58) TP53TPMTTTRHMGB1HPGD
SCHEMBL10942697 0.71 TP53 (0.53) TDP1TP53TPMTTTRHMGB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10087285-B2 Biocompatible iodinated diphenol monomers and polymers RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-10-02 US disclosed
EP-3237487-A2 BIOCOMPATIBLE IODINATED DIPHENOL MONOMERS AND POLYMERS Rutgers, the State University of New Jersey (US) 2017-11-01 EP disclosed
WO-2016103224-A2 BIOCOMPATIBLE IODINATED DIPHENOL MONOMERS AND POLYMERS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-06-30 WO disclosed
US-20160177028-A1 BIOCOMPATIBLE IODINATED DIPHENOL MONOMERS AND POLYMERS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2016-06-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10087285-B2 Biocompatible iodinated diphenol monomers and polymers DDT, HPGDS, PTGDR TDP1 2821/4885TP53 454/4885TPMT 2599/4885
US-20160177028-A1 BIOCOMPATIBLE IODINATED DIPHENOL MONOMERS AND POLYMERS DDT, HPGDS, PTGDR TDP1 2821/4885TP53 454/4885TPMT 2599/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.